5-Ethyl-2-indolecarboxylic acid
TL;DR: 5-Ethyl-2-indolecarboxylic acid (CAS 37291-85-3) is a chemical compound with molecular formula C11H11NO2 and molecular weight 189.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-1H-indole-2-carboxylic acid
Also Known As: 5-ethyl-1H-indole-2-carboxylic acid, 5-ETHYLINDOLE-2-CARBOXYLIC ACID, 5-ethyl-2-indolecarboxylic acid, Bis-(4-chlorophenoxy)methane, 5-Aethyl-indol-2-carbonsaeure
| Molecular Formula | C11H11NO2 |
|---|---|
| Molecular Weight | 189.08 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 53.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 189.07898 |
| Heavy Atoms | 14 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 37291-85-3 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1)NC(=C2)C(=O)O |
| InChIKey | SJOATWVSOUYAPP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Ethyl-2-indolecarboxylic acid (CAS 37291-85-3), with molecular formula C11H11NO2 and molecular weight 189.08 g/mol. IUPAC: 5-ethyl-1H-indole-2-carboxylic acid.
Chemical Property Profile of 5-Ethyl-2-indolecarboxylic acid
Property Insights of 5-Ethyl-2-indolecarboxylic acid
The XLogP value of 3.1 indicates that 5-Ethyl-2-indolecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.1 Ų, 5-Ethyl-2-indolecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethyl-2-indolecarboxylic acid has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Ethyl-2-indolecarboxylic acid?
The CAS number of 5-Ethyl-2-indolecarboxylic acid is 37291-85-3.
What is the molecular formula of 5-Ethyl-2-indolecarboxylic acid?
The molecular formula of 5-Ethyl-2-indolecarboxylic acid is C11H11NO2.
What is the molecular weight of 5-Ethyl-2-indolecarboxylic acid?
The molecular weight of 5-Ethyl-2-indolecarboxylic acid is 189.08 g/mol.
Where can I buy 5-Ethyl-2-indolecarboxylic acid?
You can request a quote for 5-Ethyl-2-indolecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethyl-2-indolecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethyl-2-indolecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.